01-5300
正戊醇
SAJ first grade, ≥97.0%
别名:
戊醇, 正戊醇
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关于此项目
线性分子式:
CH3(CH2)4OH
化学文摘社编号:
分子量:
88.15
EC Number:
200-752-1
UNSPSC Code:
12352001
PubChem Substance ID:
Beilstein/REAXYS Number:
1730975
MDL number:
InChI key
AMQJEAYHLZJPGS-UHFFFAOYSA-N
InChI
1S/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3
SMILES string
CCCCCO
grade
SAJ first grade
vapor density
3 (vs air)
vapor pressure
1 mmHg ( 13.6 °C), 1.5 mmHg ( 20 °C)
assay
≥97.0%
form
liquid
expl. lim.
10 %, 100 °F
availability
available only in Japan
refractive index
n20/D 1.409 (lit.)
pH
7
bp
136-138 °C (lit.)
mp
−78 °C (lit.)
density
0.811 g/mL at 25 °C (lit.)
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signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Inhalation - Eye Dam. 1 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
3 - Flammable liquids
wgk
WGK 1
flash_point_f
120.2 °F - closed cup
flash_point_c
49 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
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In the recent years, Slater-type geminals (STGs) have been used with great success to expand the first-order wave function in an explicitly-correlated perturbation theory. The present work reports on this theory's implementation in the framework of the Turbomole suite of
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